Just to clarify to the rest of the list on this, the pattern would be
[$(N1(a)CCNCC1)]
or being more specific and faster - restrict attachments to the piperizine
ring.
[0Nv3D3+0$(*(a)1[CD2v4][CD2v4][ND2v3][CD2v4][CD2v4]1)]
Rereading now I read $pipN=N(c)(C)(C) as having an N=N but I guess
Does the latest CDK SMARTS functionality support the feature described
below?
-- Forwarded message --
From: John H Van Drie j...@vandrieresearch.com
Date: Thu, May 7, 2015 at 1:08 PM
Subject: Re: CDKPsearch speed
To: rajarshi.g...@gmail.com
BTW, in the Daylight SMARTS handling,
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